Geometry & MOs

Info

ID:	285307
PubChem CID:	104099000
Reduced:	ON4C15H20 (1)
Stoich.:	AB4C15D20 (1)
Weight, g/mol:	236.200097
ΔH_f, kcal/mol:	25.91
Dipole, Da:	5.76
IP(EA), eV:	-8.72(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-propan-2-yl-N-[2-(triazol-1-yl)ethyl]cyclohexan-1-amine

Drug info:

PubChemData

Smile

CC1(CC2=C(O1)C(=CC=C2)CNCCN3C=CN=N3)C

DOS

IR

Vibrations